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2-Propanone, 3-phenyl-1,1-bis(phenylthio)-
SpectraBase Compound ID 5Kw9NM66ex0
InChI InChI=1S/C21H18OS2/c22-20(16-17-10-4-1-5-11-17)21(23-18-12-6-2-7-13-18)24-19-14-8-3-9-15-19/h1-15,21H,16H2
InChIKey XPAWYIGYJZAEEG-UHFFFAOYSA-N
Mol Weight 350.49 g/mol
Molecular Formula C21H18OS2
Exact Mass 350.079908 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6NzHwi5YJP9
Name 2-Propanone, 3-phenyl-1,1-bis(phenylthio)-
Alternate Name(s) 1,1-bis(phenylthio)-3-phenyl-2-propanone 1,1-bis(phenylthio)-3-phenyl-propan-2-one 3-Phenyl-1,1-bis(phenylsulfanyl)acetone
CAS Registry Number 111731-03-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H18OS2
InChI InChI=1S/C21H18OS2/c22-20(16-17-10-4-1-5-11-17)21(23-18-12-6-2-7-13-18)24-19-14-8-3-9-15-19/h1-15,21H,16H2
InChIKey XPAWYIGYJZAEEG-UHFFFAOYSA-N
Molecular Weight 350.494 g/mol
SMILES C(C(Cc1ccccc1)=O)(Sc1ccccc1)Sc1ccccc1
SPLASH splash10-001i-5980000000-544c798866df2986872a
Source of Spectrum F-43-2480-3
Wiley ID 1342040